2-[4-(azanylidenemethylidene)piperazin-4-ium-1-yl]-5-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)benzenecarbonitrile

Systemtic Name: 2-[4-(azanylidenemethylidene)piperazin-4-ium-1-yl]-5-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)benzenecarbonitrile Openeye Name: 2-[4-(iminomethylene)piperazin-4-ium-1-yl]-5-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzonitrile CAS Name: 2-[4-(iminomethylidene)-1-piperazin-4-iumyl]-5-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzonitrile IUPAC Name: 2-[4-(iminomethylidene)piperazin-4-ium-1-yl]-5-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzonitrile Traditional Name: 2-[4-(iminomethylene)piperazin-4-ium-1-yl]-5-(6-keto-4,5-dihydro-1H-pyridazin-3-yl)benzonitrile Formula: C16H17N6O+ MolecularWeight: 309.34578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NN=C1C2=CC(=C(C=C2)N3CC[N+](=C=N)CC3)C#N

Isomeric SMILES

C1CC(=O)NN=C1C2=CC(=C(C=C2)N3CC[N+](=C=N)CC3)C#N

InChI

InChI=1S/C16H16N6O/c17-10-13-9-12(14-2-4-16(23)20-19-14)1-3-15(13)22-7-5-21(11-18)6-8-22/h1,3,9,18H,2,4-8H2/p+1